| SpectraBase Compound ID | 6pmmLxSOOQe |
|---|---|
| InChI | InChI=1S/C13H8F3NO/c14-8-4-6-9(7-5-8)17-13(18)12-10(15)2-1-3-11(12)16/h1-7H,(H,17,18) |
| InChIKey | MFIQCQLLSWDESU-UHFFFAOYSA-N |
| Mol Weight | 251.21 g/mol |
| Molecular Formula | C13H8F3NO |
| Exact Mass | 251.055798 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | FLjP8JeRtXH |
|---|---|
| Name | Benzamide, N-(4-fluorophenyl)-2,6-difluoro- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 251.055798370 u |
| Formula | C13H8F3NO |
| InChI | InChI=1S/C13H8F3NO/c14-8-4-6-9(7-5-8)17-13(18)12-10(15)2-1-3-11(12)16/h1-7H,(H,17,18) |
| InChIKey | MFIQCQLLSWDESU-UHFFFAOYSA-N |
| Molecular Weight | 251.208 g/mol |
| SMILES | C1=CC=C(C(=C1F)C(NC1=CC=C(C=C1)F)=O)F |